4-[(2-methoxycarbonyl-2-methyl-butoxy)methoxy]-2-[2-(prop-1-en-2-yloxymethoxy)ethoxycarbonyl]benzoic acid

Systemtic Name: 4-[(2-methoxycarbonyl-2-methyl-butoxy)methoxy]-2-[2-(prop-1-en-2-yloxymethoxy)ethoxycarbonyl]benzoic acid Openeye Name: 2-[2-(isopropenyloxymethoxy)ethoxycarbonyl]-4-[(2-methoxycarbonyl-2-methyl-butoxy)methoxy]benzoic acid CAS Name: 4-[(2-methoxycarbonyl-2-methylbutoxy)methoxy]-2-[2-(1-methylethenoxymethoxy)ethoxy-oxomethyl]benzoic acid IUPAC Name: 4-[(2-methoxycarbonyl-2-methylbutoxy)methoxy]-2-[2-(prop-1-en-2-yloxymethoxy)ethoxycarbonyl]benzoic acid Traditional Name: 4-[(2-carbomethoxy-2-methyl-butoxy)methoxy]-2-[2-(isopropenyloxymethoxy)ethoxycarbonyl]benzoic acid Formula: C22H30O10 MolecularWeight: 454.4676

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(COCOC1=CC(=C(C=C1)C(=O)O)C(=O)OCCOCOC(=C)C)C(=O)OC

Isomeric SMILES

CCC(C)(COCOC1=CC(=C(C=C1)C(=O)O)C(=O)OCCOCOC(=C)C)C(=O)OC

InChI

InChI=1S/C22H30O10/c1-6-22(4,21(26)27-5)12-29-14-32-16-7-8-17(19(23)24)18(11-16)20(25)30-10-9-28-13-31-15(2)3/h7-8,11H,2,6,9-10,12-14H2,1,3-5H3,(H,23,24)